2-[(6,7-dimethyl-1H-indol-3-yl)methyl]cyclopentan-1-amine

C16H22N2 — CID 84630491

IUPAC2-[(6,7-dimethyl-1H-indol-3-yl)methyl]cyclopentan-1-amine
SMILESCc1ccc2c(CC3CCCC3N)c[nH]c2c1C
InChIInChI=1S/C16H22N2/c1-10-6-7-14-13(9-18-16(14)11(10)2)8-12-4-3-5-15(12)17/h6-7,9,12,15,18H,3-5,8,17H2,1-2H3
InChIKeyKCLFHSCVQXFKJZ-UHFFFAOYSA-N
MW242.37 g/mol
LogP3.45
Rot. Bonds2

About 2-[(6,7-dimethyl-1H-indol-3-yl)methyl]cyclopentan-1-amine

2-[(6,7-dimethyl-1H-indol-3-yl)methyl]cyclopentan-1-amine (PubChem CID 84630491) has the molecular formula C16H22N2 and a molecular weight of 242.37 g/mol. Its IUPAC name is 2-[(6,7-dimethyl-1H-indol-3-yl)methyl]cyclopentan-1-amine.

Molecular Properties

Compound Name2-[(6,7-dimethyl-1H-indol-3-yl)methyl]cyclopentan-1-amine
PubChem CID84630491
Molecular FormulaC16H22N2
Molecular Weight242.37 g/mol
Exact Mass242.18
IUPAC Name2-[(6,7-dimethyl-1H-indol-3-yl)methyl]cyclopentan-1-amine
SMILESCc1ccc2c(CC3CCCC3N)c[nH]c2c1C
InChIInChI=1S/C16H22N2/c1-10-6-7-14-13(9-18-16(14)11(10)2)8-12-4-3-5-15(12)17/h6-7,9,12,15,18H,3-5,8,17H2,1-2H3
InChIKeyKCLFHSCVQXFKJZ-UHFFFAOYSA-N
XLogP3.45
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.37
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 2-[(6,7-dimethyl-1H-indol-3-yl)methyl]cyclopentan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[(6,7-dimethyl-1H-indol-3-yl)methyl]cyclopentan-1-amine?
The IUPAC name of 2-[(6,7-dimethyl-1H-indol-3-yl)methyl]cyclopentan-1-amine (CID 84630491) is 2-[(6,7-dimethyl-1H-indol-3-yl)methyl]cyclopentan-1-amine.
What is the SMILES notation for 2-[(6,7-dimethyl-1H-indol-3-yl)methyl]cyclopentan-1-amine?
The canonical SMILES for 2-[(6,7-dimethyl-1H-indol-3-yl)methyl]cyclopentan-1-amine is Cc1ccc2c(CC3CCCC3N)c[nH]c2c1C.
What is the InChIKey of 2-[(6,7-dimethyl-1H-indol-3-yl)methyl]cyclopentan-1-amine?
The InChIKey is KCLFHSCVQXFKJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2/c1-10-6-7-14-13(9-18-16(14)11(10)2)8-12-4-3-5-15(12)17/h6-7,9,12,15,18H,3-5,8,17H2,1-2H3.
What are the key properties of 2-[(6,7-dimethyl-1H-indol-3-yl)methyl]cyclopentan-1-amine?
2-[(6,7-dimethyl-1H-indol-3-yl)methyl]cyclopentan-1-amine has a molecular weight of 242.37 g/mol, XLogP of 3.45, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6,7-dimethyl-1H-indol-3-yl)methyl]cyclopentan-1-amine is sourced from PubChem (CID 84630491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).